Chemical Properties of 1,2-Propanediol, 3-phenoxy- (CAS 538-43-2)

InChI

InChI=1S/C9H12O3/c10-6-8(11)7-12-9-4-2-1-3-5-9/h1-5,8,10-11H,6-7H2

InChI Key

FNQIYTUXOKTMDM-UHFFFAOYSA-N

Formula

C9H12O3

SMILES

OCC(O)COc1ccccc1

Molecular Weight¹

168.19

CAS

538-43-2

Other Names

• Antodyne
• Glycerol «alpha»-monophenyl ether
• Glycerol «alpha»-phenyl ether
• Phenol glyceryl ether
• Phenylglyceryl ether
• 3-Phenoxy-1,2-propanediol
• Phenol glycerol ether
• Phenol-glycerinaether
• Phenyl-«alpha»-glycerol ether
• Antodyn
• 1-Fenoxy-2,3-propandiol
• 1-Phenoxy-2,3-propanediol
• U 27,462
• 1,2-Dihydroxy-3-phenoxypropane
• NSC 406489
• «alpha»-Phenyl monoglyceryl ether
• 3-phenoxypropane-1,2-diol

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[338.80; 389.34]	J/mol×K	[638.34; 825.22]
Cp,gas	338.80	J/mol×K	638.34	Joback Calculated Property
Cp,gas	348.52	J/mol×K	669.49	Joback Calculated Property
Cp,gas	357.70	J/mol×K	700.63	Joback Calculated Property
Cp,gas	366.35	J/mol×K	731.78	Joback Calculated Property
Cp,gas	374.50	J/mol×K	762.92	Joback Calculated Property
Cp,gas	382.16	J/mol×K	794.07	Joback Calculated Property
Cp,gas	389.34	J/mol×K	825.22	Joback Calculated Property
η	[0.0000188; 0.0104619]	Pa×s	[346.48; 638.34]
η	0.0104619	Pa×s	346.48	Joback Calculated Property
η	0.0019072	Pa×s	395.12	Joback Calculated Property
η	0.0005049	Pa×s	443.77	Joback Calculated Property
η	0.0001738	Pa×s	492.41	Joback Calculated Property
η	0.0000725	Pa×s	541.05	Joback Calculated Property
η	0.0000349	Pa×s	589.70	Joback Calculated Property
η	0.0000188	Pa×s	638.34	Joback Calculated Property
ΔfusH	28.00	kJ/mol	331.70	NIST

Similar Compounds

Find more compounds similar to 1,2-Propanediol, 3-phenoxy-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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